Structure of PDB 6n7l Chain A Binding Site BS03

Receptor Information

>6n7l Chain A (length=342) Species: 1338011 (Elizabethkingia anophelis NUHP1)

MIPKTMKAAVVQGYGEPLKIQEVPVREPGRYEVLVKVMACGVCHTDLHAV
DGDWPAKPKMPLIPGHEGVGIVVACGPDAMVKEGDAVGVPWLYSACGCCD
YCITGWETLCEAQQNGGYSVDGGFAEYVIADSRYVGHLKSNVNFLEIAPI
LCAGVTVYKGLKETETKPGEWVAISGIGGLGHVAVQYAKAMGMHVAAIDV
ADDKLELAKKLGADLTVNAKTTDPGTYLHKEVGGMHGALITAVSPIAFKQ
GIDVLRRKGTIALNGLPPGSFELPIFETVLKRITVRGSIVGTRKDLQEAL
DFANEGLVKATVTSAKLEDINDVFDKMKKGQIDGRIVLDIAG

Ligand information

• Ligand ID: ZN
• InChI: InChI=1S/Zn/q+2
• InChIKey: PTFCDOFLOPIGGS-UHFFFAOYSA-N
• SMILES:
  CACTVS 3.341: [Zn++]
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Zn+2]
• Formula: Zn
• Name: ZINC ION
• ChEMBL: CHEMBL1236970
• DrugBank: DB14532
• PDB chain: 6n7l Chain A Residue 414

Receptor-Ligand Complex Structure

Structure summary

• PDB: 6n7l Crystal structure of an alcohol dehydrogenase from Elizabethkingia anophelis NUHP1
• Resolution: 2.1 Å
• Binding residue (original residue number in PDB): C96 C99 C102 C110
• Binding residue (residue number reindexed from 1): C96 C99 C102 C110
• Annotation score: 1

Enzymatic activity

• Catalytic site (original residue number in PDB): C43 T45 H48 H66 C152
• Catalytic site (residue number reindexed from 1): C43 T45 H48 H66 C152
• Enzyme Commision number: 1.1.1.1: alcohol dehydrogenase.

Gene Ontology

Molecular Function

• GO:0000166 nucleotide binding
• GO:0008270 zinc ion binding
• GO:0016491 oxidoreductase activity
• GO:0046872 metal ion binding

External links

• PDB: RCSB:6n7l, PDBe:6n7l, PDBj:6n7l
• PDBsum: 6n7l
• UniProt: A0A077EGR8